6049-1909 Screening compound: 5-(4-methylphenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide

6049-1909 Screening compound: 5-(4-methylphenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide
6049-1909 Screening compound: 5-(4-methylphenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6049-1909
5-(4-methylphenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

6049-1909

Molecular Formula

C22H25F3N6O (C22 H25 F3 N6 O)

Compound Name

5-(4-methylphenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide

IUPAC name

5-(4-methylphenyl)-7-(trifluoromethyl)-N-[(135-trimethyl-1H-pyrazol-4-yl)methyl]-4H5H6H7H-pyrazolo[15-a]pyrimidine-2-carboxamide

SMILES

Cc1c(CNC(c2nn(C(CC(c3ccc(C)cc3)N3)C(F)(F)F)c3c2)=O)c(C)nn1C

InChI

InChI=1S/C22H25F3N6O/c1-12-5-7-15(8-6-12)17-9-19(22(23,24)25)31-20(27-17)10-18(29-31)21(32)26-11-16-13(2)28-30(4)14(16)3/h5-8,10,17,19,27H,9,11H2,1-4H3,(H,26,32)

InChI Key

WNQKLADTAQMWPJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01922799

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.473

Distribution Coefficient, logD

3.473

Water Solubility, LogSw

-3.78

Polar Surface Area

67.019

Acid Dissociation Constant (pKa)

13.61

Base Dissociation Constant (pKb)

1.05

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

40.90

6049-1909 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6049-1909 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6049-1909?
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What is the minimum amount of 6049-1909 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6049-1909
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6049-1909
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 6049-1909 available by request